N-[(adamantan-1-yl)methyl]-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(adamantan-1-yl)methyl]-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
N-[(adamantan-1-yl)methyl]-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-2394 |
| Compound Name: | N-[(adamantan-1-yl)methyl]-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 341.37 |
| Molecular Formula: | C17 H22 F3 N3 O |
| Smiles: | Cn1c(cc(C(NCC23CC4CC(CC(C4)C3)C2)=O)n1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.9747 |
| logD: | 3.9747 |
| logSw: | -4.1254 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.201 |
| InChI Key: | RENFLFZKPACOPG-UHFFFAOYSA-N |